Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gja_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 THR 4.A OG1 no hydrogen 3.151 N/A PHE 3.A N ASP 81.A OD2 no hydrogen 2.977 N/A THR 4.A N ASN 2.A OD1 no hydrogen 2.584 N/A THR 4.A OG1 ASN 2.A OD1 no hydrogen 2.935 N/A PHE 5.A N SER 85.A OG no hydrogen 2.878 N/A SER 6.A N GLU 9.A OE1 no hydrogen 2.765 N/A GLU 9.A N SER 6.A OG no hydrogen 3.104 N/A VAL 10.A N SER 6.A O no hydrogen 3.072 N/A ALA 11.A N PRO 7.A O no hydrogen 3.101 N/A ARG 12.A N GLU 8.A O no hydrogen 2.859 N/A ARG 12.A NH2 GLU 8.A OE2 no hydrogen 3.524 N/A PHE 13.A N GLU 9.A O no hydrogen 2.963 N/A GLU 14.A N VAL 10.A O no hydrogen 2.925 N/A ARG 15.A N ALA 11.A O no hydrogen 3.086 N/A ARG 15.A N ARG 12.A O no hydrogen 3.175 N/A ASP 16.A N ARG 12.A O no hydrogen 2.977 N/A GLY 17.A N PHE 13.A O no hydrogen 2.719 N/A ILE 19.A N ILE 181.A O no hydrogen 2.743 N/A VAL 22.A N ALA 179.A O no hydrogen 2.887 N/A LYS 23.A NZ GLU 26.A OE2 no hydrogen 2.702 N/A ILE 24.A N GLY 177.A O no hydrogen 2.845 N/A PHE 25.A N GLY 177.A O no hydrogen 3.086 N/A MET 30.A N GLU 26.A O no hydrogen 2.931 N/A THR 31.A N PRO 27.A O no hydrogen 3.032 N/A THR 31.A OG1 PRO 27.A O no hydrogen 3.169 N/A ARG 32.A N GLU 28.A O no hydrogen 2.958 N/A ARG 32.A NH1 GLU 29.A OE2 no hydrogen 2.591 N/A ARG 33.A N GLU 29.A O no hydrogen 3.070 N/A ARG 33.A NE GLU 29.A OE2 no hydrogen 2.775 N/A ARG 33.A NH1 GLU 72.A OE1 no hydrogen 3.261 N/A ARG 33.A NH2 GLU 72.A OE1 no hydrogen 3.424 N/A ARG 33.A NH2 GLU 72.A OE2 no hydrogen 3.062 N/A TRP 34.A N MET 30.A O no hydrogen 2.860 N/A TRP 34.A NE1 TYR 200.A OH no hydrogen 2.743 N/A ASN 35.A N THR 31.A O no hydrogen 2.855 N/A ILE 37.A N ARG 33.A O no hydrogen 2.802 N/A ARG 38.A N TRP 34.A O no hydrogen 2.903 N/A GLN 40.A N ILE 36.A O no hydrogen 3.077 N/A LEU 41.A N ILE 37.A O no hydrogen 2.855 N/A LEU 42.A N ARG 39.A O no hydrogen 3.042 N/A ASP 43.A N GLN 40.A O no hydrogen 3.216 N/A ARG 44.A NH2 TYR 49.A O no hydrogen 2.820 N/A SER 45.A N ASP 43.A OD1 no hydrogen 2.817 N/A SER 45.A OG ASP 43.A OD1 no hydrogen 3.011 N/A SER 45.A OG ASP 43.A OD2 no hydrogen 3.524 N/A ALA 47.A N ARG 44.A O no hydrogen 2.908 N/A TYR 49.A OH ASP 62.A OD2 no hydrogen 2.741 N/A GLY 54.A N SER 52.A OG no hydrogen 3.038 N/A ALA 56.A N ASP 227.A O no hydrogen 2.940 N/A ASN 57.A N GLY 54.A O no hydrogen 3.110 N/A ASN 57.A ND2 PRO 50.A O no hydrogen 3.280 N/A ILE 58.A N GLY 54.A O no hydrogen 3.049 N/A SER 59.A N LYS 55.A O no hydrogen 2.716 N/A ASN 60.A N ASN 57.A O no hydrogen 3.031 N/A TYR 61.A N ALA 56.A O no hydrogen 2.759 N/A ASP 62.A N SER 96.A O no hydrogen 2.713 N/A ARG 63.A NE ASN 60.A OD1 no hydrogen 2.803 N/A ARG 63.A NH1 ASP 66.A OD1 no hydrogen 3.343 N/A ARG 63.A NH2 ASN 60.A OD1 no hydrogen 3.424 N/A HIS 64.A ND1 SER 96.A OG no hydrogen 2.830 N/A LEU 65.A N ASP 62.A O no hydrogen 3.357 N/A ASP 66.A N ARG 63.A O no hydrogen 3.101 N/A ILE 67.A N ARG 63.A O no hydrogen 2.880 N/A LEU 70.A N ILE 67.A O no hydrogen 2.939 N/A ALA 71.A N ILE 67.A O no hydrogen 2.815 N/A GLU 72.A N ASP 68.A O no hydrogen 2.862 N/A HIS 73.A N LEU 69.A O no hydrogen 3.093 N/A HIS 73.A NE2 THR 144.A OG1 no hydrogen 2.967 N/A ILE 74.A N LEU 70.A O no hydrogen 3.242 N/A MET 75.A N GLU 72.A O no hydrogen 2.985 N/A ARG 76.A N HIS 73.A O no hydrogen 3.196 N/A ARG 76.A NH1 GLU 78.A OE1 no hydrogen 3.522 N/A ARG 76.A NH1 GLU 78.A OE2 no hydrogen 2.942 N/A ARG 76.A NH2 GLU 72.A OE2 no hydrogen 2.822 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.564 N/A ILE 79.A N ARG 76.A O no hydrogen 2.804 N/A VAL 80.A N ARG 76.A O no hydrogen 2.726 N/A ASP 81.A N PRO 77.A O no hydrogen 2.826 N/A ARG 82.A NE GLU 78.A O no hydrogen 2.694 N/A ARG 82.A NH2 GLU 78.A O no hydrogen 3.368 N/A VAL 83.A N ILE 79.A O no hydrogen 2.890 N/A GLY 84.A N VAL 80.A O no hydrogen 2.823 N/A SER 85.A N ASP 81.A O no hydrogen 3.177 N/A SER 85.A N ARG 82.A O no hydrogen 3.207 N/A SER 85.A OG ASP 81.A O no hydrogen 2.701 N/A LEU 86.A N VAL 83.A O no hydrogen 2.771 N/A ILE 87.A N VAL 83.A O no hydrogen 3.018 N/A GLY 88.A N GLY 84.A O no hydrogen 2.942 N/A LEU 92.A N VAL 209.A O no hydrogen 2.913 N/A CYS 93.A N VAL 237.A O no hydrogen 2.742 N/A CYS 93.A SG ARG 95.A O no hydrogen 3.721 N/A CYS 93.A SG ARG 207.A O no hydrogen 3.832 N/A TRP 94.A N ARG 207.A O no hydrogen 3.123 N/A TRP 94.A NE1 THR 139.A OG1 no hydrogen 2.905 N/A ARG 95.A NH2 GLN 124.A OE1 no hydrogen 2.641 N/A ARG 95.A NH2 TYR 216.A OH no hydrogen 2.798 N/A SER 96.A N ASP 62.A OD1 no hydrogen 3.015 N/A SER 96.A OG HIS 64.A ND1 no hydrogen 2.830 N/A GLU 97.A N ALA 205.A O no hydrogen 2.900 N/A PHE 98.A N SER 59.A O no hydrogen 3.222 N/A PHE 99.A N GLY 203.A O no hydrogen 2.756 N/A LYS 101.A N ARG 201.A O no hydrogen 2.893 N/A LYS 101.A NZ GLY 154.A O no hydrogen 2.981 N/A LYS 101.A NZ LEU 191.A O no hydrogen 2.656 N/A TYR 102.A N ASP 105.A OD2 no hydrogen 2.924 N/A GLY 104.A N HIS 193.A O no hydrogen 3.245 N/A ASP 105.A N TYR 102.A O no hydrogen 2.980 N/A THR 108.A N SER 190.A O no hydrogen 2.818 N/A THR 108.A OG1 SER 190.A OG no hydrogen 3.300 N/A TRP 110.A N ASP 109.A OD1 no hydrogen 2.690 N/A HIS 111.A N HIS 188.A O no hydrogen 2.900 N/A HIS 111.A ND1 ASP 109.A O no hydrogen 2.883 N/A THR 115.A OG1 ILE 137.A O no hydrogen 2.686 N/A ALA 117.A N LYS 122.A O no hydrogen 2.747 N/A ALA 119.A N ASP 227.A OD2 no hydrogen 3.019 N/A GLY 121.A N ALA 117.A O no hydrogen 2.593 N/A LYS 122.A N THR 120.A OG1 no hydrogen 3.362 N/A GLN 124.A N THR 115.A O no hydrogen 3.252 N/A GLN 124.A NE2 THR 115.A O no hydrogen 2.909 N/A ILE 126.A N GLN 214.A O no hydrogen 3.075 N/A TRP 127.A N PHE 136.A O no hydrogen 3.073 N/A TRP 127.A NE1 GLY 138.A O no hydrogen 2.803 N/A SER 129.A OG ARG 133.A O no hydrogen 3.443 N/A GLY 132.A N GLU 131.A OE1 no hydrogen 3.264 N/A THR 139.A N SER 184.A OG no hydrogen 3.070 N/A THR 139.A OG1 TYR 208.A O no hydrogen 2.725 N/A ILE 140.A N TYR 208.A O no hydrogen 2.996 N/A THR 141.A N PHE 182.A O no hydrogen 2.762 N/A THR 141.A OG1 THR 139.A O no hydrogen 3.309 N/A VAL 142.A N ALA 206.A O no hydrogen 2.830 N/A TRP 143.A N VAL 180.A O no hydrogen 2.935 N/A THR 144.A N PHE 204.A O no hydrogen 2.853 N/A THR 144.A OG1 HIS 73.A NE2 no hydrogen 2.967 N/A ALA 145.A N GLU 178.A O no hydrogen 2.873 N/A PHE 146.A N MET 202.A O no hydrogen 2.832 N/A THR 147.A N MET 202.A O no hydrogen 3.320 N/A HIS 148.A NE2 ASP 199.A OD1 no hydrogen 2.793 N/A SER 149.A N LEU 174.A O no hydrogen 2.895 N/A ASN 153.A N THR 150.A OG1 no hydrogen 2.888 N/A ASN 153.A ND2 HIS 148.A O no hydrogen 2.743 N/A ASN 153.A ND2 ASP 199.A OD1 no hydrogen 3.383 N/A GLY 154.A N GLU 151.A O no hydrogen 3.199 N/A CYS 155.A N THR 150.A O no hydrogen 2.833 N/A CYS 155.A SG LEU 156.A O no hydrogen 3.585 N/A GLN 157.A N ALA 189.A O no hydrogen 2.703 N/A GLN 157.A NE2 ALA 169.A O no hydrogen 3.423 N/A LEU 158.A N TYR 170.A O no hydrogen 3.093 N/A GLY 161.A N ASP 16.A OD1 no hydrogen 3.153 N/A THR 162.A OG1 ARG 15.A O no hydrogen 3.305 N/A MET 172.A N LEU 156.A O no hydrogen 2.941 N/A LEU 174.A N SER 149.A O no hydrogen 2.878 N/A LYS 175.A N GLU 178.A OE1 no hydrogen 2.676 N/A GLY 177.A N ALA 145.A O no hydrogen 2.880 N/A GLU 178.A N LYS 175.A O no hydrogen 2.975 N/A ALA 179.A N VAL 22.A O no hydrogen 2.838 N/A VAL 180.A N TRP 143.A O no hydrogen 3.017 N/A ILE 181.A N ILE 19.A O no hydrogen 2.836 N/A PHE 182.A N THR 141.A O no hydrogen 2.955 N/A TRP 183.A N GLY 17.A O no hydrogen 3.085 N/A SER 184.A N THR 139.A O no hydrogen 2.897 N/A SER 184.A OG THR 139.A O no hydrogen 3.330 N/A THR 186.A N TRP 183.A O no hydrogen 2.929 N/A THR 186.A OG1 GLY 17.A O no hydrogen 2.831 N/A THR 186.A OG1 TRP 183.A O no hydrogen 3.035 N/A HIS 188.A N HIS 111.A O no hydrogen 3.009 N/A HIS 188.A ND1 THR 186.A O no hydrogen 3.206 N/A ALA 189.A N GLN 157.A O no hydrogen 2.854 N/A SER 190.A N THR 108.A O no hydrogen 3.196 N/A LEU 191.A N CYS 155.A O no hydrogen 3.153 N/A HIS 193.A N ASP 105.A O no hydrogen 2.817 N/A HIS 193.A NE2 ASP 199.A O no hydrogen 2.662 N/A THR 194.A N GLN 152.A O no hydrogen 2.910 N/A GLY 195.A N HIS 193.A ND1 no hydrogen 3.065 N/A SER 196.A OG THR 198.A OG1 no hydrogen 3.325 N/A LYS 197.A NZ GLN 103.A OE1 no hydrogen 2.715 N/A THR 198.A OG1 SER 196.A OG no hydrogen 3.325 N/A ASP 199.A N SER 196.A O no hydrogen 3.101 N/A ARG 201.A N LYS 101.A O no hydrogen 2.975 N/A ARG 201.A NH1 PHE 99.A O no hydrogen 2.927 N/A ARG 201.A NH2 GLY 154.A O no hydrogen 3.026 N/A GLY 203.A N PHE 99.A O no hydrogen 3.071 N/A PHE 204.A N THR 144.A O no hydrogen 2.784 N/A ALA 205.A N GLU 97.A O no hydrogen 2.876 N/A ALA 206.A N VAL 142.A O no hydrogen 2.980 N/A ARG 207.A N ARG 95.A O no hydrogen 2.696 N/A ARG 207.A NH1 GLU 97.A OE2 no hydrogen 3.036 N/A ARG 207.A NH2 THR 141.A OG1 no hydrogen 2.866 N/A TYR 208.A N ILE 140.A O no hydrogen 2.662 N/A TYR 208.A OH ILE 74.A O no hydrogen 2.857 N/A VAL 209.A N LEU 92.A O no hydrogen 2.874 N/A THR 211.A N ASN 90.A O no hydrogen 3.105 N/A VAL 213.A N PRO 210.A O no hydrogen 2.925 N/A GLN 214.A N ILE 126.A O no hydrogen 2.929 N/A VAL 215.A N ASN 248.A OD1 no hydrogen 2.601 N/A TYR 216.A N GLN 124.A O no hydrogen 2.824 N/A THR 219.A OG1 TYR 216.A O no hydrogen 2.775 N/A THR 219.A OG1 PRO 217.A O no hydrogen 3.281 N/A LEU 222.A N THR 219.A O no hydrogen 3.089 N/A GLU 224.A N THR 223.A OG1 no hydrogen 2.711 N/A TYR 225.A N ILE 229.A O no hydrogen 2.823 N/A ILE 229.A N GLY 226.A O no hydrogen 2.965 N/A LEU 231.A N THR 223.A O no hydrogen 2.753 N/A TYR 234.A N LEU 231.A O no hydrogen 2.965 N/A TYR 234.A OH TRP 94.A O no hydrogen 2.650 N/A ALA 236.A N ARG 249.A O no hydrogen 2.838 N/A VAL 237.A N CYS 93.A O no hydrogen 2.984 N/A THR 239.A N LEU 91.A O no hydrogen 2.792 N/A THR 239.A OG1 LEU 91.A O no hydrogen 3.476 N/A SER 240.A OG ARG 89.A O no hydrogen 2.497 N/A GLY 241.A N ARG 263.A O no hydrogen 3.130 N/A VAL 242.A N ASN 90.A OD1 no hydrogen 2.844 N/A TYR 245.A N ASP 243.A OD1 no hydrogen 2.899 N/A GLY 246.A N ASP 243.A OD1 no hydrogen 3.276 N/A GLY 246.A N ASP 243.A OD2 no hydrogen 3.199 N/A HIS 247.A NE2 THR 211.A O no hydrogen 2.899 N/A HIS 247.A NE2 VAL 213.A O no hydrogen 3.121 N/A ASN 248.A ND2 VAL 213.A O no hydrogen 2.704 N/A ARG 249.A NH2 THR 219.A O no hydrogen 3.056 N/A ALA 251.A N ALA 236.A O no hydrogen 2.861 N/A ARG 252.A NE GLU 259.A OE2 no hydrogen 2.773 N/A THR 253.A OG1 GLU 259.A OE1 no hydrogen 2.684 N/A THR 253.A OG1 GLU 259.A OE2 no hydrogen 3.516 N/A SER 254.A N TYR 258.A O no hydrogen 2.670 N/A GLN 255.A N LEU 65.A O no hydrogen 2.674 N/A ARG 256.A N SER 254.A OG no hydrogen 2.881 N/A ARG 256.A NH1 ASP 66.A O no hydrogen 2.514 N/A GLY 257.A N SER 254.A O no hydrogen 2.855 N/A TYR 258.A N SER 254.A OG no hydrogen 2.967 N/A PHE 260.A N ARG 252.A O no hydrogen 2.869 N/A ARG 263.A N THR 239.A O no hydrogen 3.082 N/A ARG 263.A NE ASP 81.A OD1 no hydrogen 2.667 N/A ARG 263.A NH2 ALA 1.A O no hydrogen 3.204 N/A ARG 263.A NH2 ASP 81.A OD1 no hydrogen 3.463 N/A ARG 263.A NH2 ASP 81.A OD2 no hydrogen 2.729 N/A GLN 264.A NE2 GLY 241.A O no hydrogen 2.961 N/A GLN 264.A NE2 PRO 262.A O no hydrogen 3.625 N/A